2-(1-adamantyl)-N-(1-hydroxy-2-methylpropan-2-yl)acetamide

C16H27NO2 — CID 2874063

IUPAC2-(1-adamantyl)-N-(1-hydroxy-2-methylpropan-2-yl)acetamide
SMILESCC(C)(CO)NC(=O)CC12CC3CC(CC(C3)C1)C2
InChIInChI=1S/C16H27NO2/c1-15(2,10-18)17-14(19)9-16-6-11-3-12(7-16)5-13(4-11)8-16/h11-13,18H,3-10H2,1-2H3,(H,17,19)
InChIKeyRJSWLQWTKUHCAN-UHFFFAOYSA-N
MW265.40 g/mol
LogP2.48
Rot. Bonds4

About 2-(1-adamantyl)-N-(1-hydroxy-2-methylpropan-2-yl)acetamide

2-(1-adamantyl)-N-(1-hydroxy-2-methylpropan-2-yl)acetamide (PubChem CID 2874063) has the molecular formula C16H27NO2 and a molecular weight of 265.40 g/mol. Its IUPAC name is 2-(1-adamantyl)-N-(1-hydroxy-2-methylpropan-2-yl)acetamide.

Molecular Properties

Compound Name2-(1-adamantyl)-N-(1-hydroxy-2-methylpropan-2-yl)acetamide
PubChem CID2874063
Molecular FormulaC16H27NO2
Molecular Weight265.40 g/mol
Exact Mass265.20
IUPAC Name2-(1-adamantyl)-N-(1-hydroxy-2-methylpropan-2-yl)acetamide
SMILESCC(C)(CO)NC(=O)CC12CC3CC(CC(C3)C1)C2
InChIInChI=1S/C16H27NO2/c1-15(2,10-18)17-14(19)9-16-6-11-3-12(7-16)5-13(4-11)8-16/h11-13,18H,3-10H2,1-2H3,(H,17,19)
InChIKeyRJSWLQWTKUHCAN-UHFFFAOYSA-N
XLogP2.48
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.40
LogP ≤ 52.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(1-adamantyl)-N-(1-hydroxy-2-methylpropan-2-yl)acetamide?
The IUPAC name of 2-(1-adamantyl)-N-(1-hydroxy-2-methylpropan-2-yl)acetamide (CID 2874063) is 2-(1-adamantyl)-N-(1-hydroxy-2-methylpropan-2-yl)acetamide.
What is the SMILES notation for 2-(1-adamantyl)-N-(1-hydroxy-2-methylpropan-2-yl)acetamide?
The canonical SMILES for 2-(1-adamantyl)-N-(1-hydroxy-2-methylpropan-2-yl)acetamide is CC(C)(CO)NC(=O)CC12CC3CC(CC(C3)C1)C2.
What is the InChIKey of 2-(1-adamantyl)-N-(1-hydroxy-2-methylpropan-2-yl)acetamide?
The InChIKey is RJSWLQWTKUHCAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27NO2/c1-15(2,10-18)17-14(19)9-16-6-11-3-12(7-16)5-13(4-11)8-16/h11-13,18H,3-10H2,1-2H3,(H,17,19).
What are the key properties of 2-(1-adamantyl)-N-(1-hydroxy-2-methylpropan-2-yl)acetamide?
2-(1-adamantyl)-N-(1-hydroxy-2-methylpropan-2-yl)acetamide has a molecular weight of 265.40 g/mol, XLogP of 2.48, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-adamantyl)-N-(1-hydroxy-2-methylpropan-2-yl)acetamide is sourced from PubChem (CID 2874063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).